(2R)-N-(1,3-benzodioxol-5-yl)-2-[1-(phenylmethyl)imidazol-2-yl]sulfanyl-propanamide

Systemtic Name: (2R)-N-(1,3-benzodioxol-5-yl)-2-[1-(phenylmethyl)imidazol-2-yl]sulfanyl-propanamide Openeye Name: (2R)-N-(1,3-benzodioxol-5-yl)-2-(1-benzylimidazol-2-yl)sulfanyl-propanamide CAS Name: (2R)-N-(1,3-benzodioxol-5-yl)-2-[[1-(phenylmethyl)-2-imidazolyl]thio]propanamide IUPAC Name: (2R)-N-(1,3-benzodioxol-5-yl)-2-(1-benzylimidazol-2-yl)sulfanylpropanamide Traditional Name: (2R)-N-(1,3-benzodioxol-5-yl)-2-[(1-benzylimidazol-2-yl)thio]propionamide Formula: C20H19N3O3S MolecularWeight: 381.44816

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC2=C(C=C1)OCO2)SC3=NC=CN3CC4=CC=CC=C4

Isomeric SMILES

C[C@H](C(=O)NC1=CC2=C(C=C1)OCO2)SC3=NC=CN3CC4=CC=CC=C4

InChI

InChI=1S/C20H19N3O3S/c1-14(19(24)22-16-7-8-17-18(11-16)26-13-25-17)27-20-21-9-10-23(20)12-15-5-3-2-4-6-15/h2-11,14H,12-13H2,1H3,(H,22,24)/t14-/m1/s1